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2-(methoxymethyl)-7-methyl-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylic acid

2-(methoxymethyl)-7-methyl-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylic acid

Formula: C9H10N4O3

SMILES: COCC1=NN2C(=N1)N=CC(C(O)=O)=C2C

IUPAC: 2-(methoxymethyl)-7-methyl-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylic acid

InChI: InChI=1S/C9H10N4O3/c1-5-6(8(14)15)3-10-9-11-7(4-16-2)12-13(5)9/h3H,4H2,1-2H3,(H,14,15)

Composition: C (48.65%), H (4.54%), N (25.21%), O (21.60%)

Molar Mass: 222.204

Atom Count: 26

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 222.075290198
Formal Charge 0
FSP3 0.33
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 6
Hydrogen Bond Donor Count 1
InChIKey BGCZSZNQTGJUMW-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 67.09
Topological Polar Surface Area 89.61
Polarizability 20.15
Ring Count 2
Rotatable Bond Count 3

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Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C9H10N4O3 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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